Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 6/20 | 0.78 |
| ▸ | GAA | P10253 | 3/20 | 0.65 |
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | CTSD | P07339 | 1/20 | 0.59 |
| ▸ | RORC | P51449 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.58 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7157849 | 0.90 | KCNMA1 (0.72) | KCNMA1GAANPC1HTTLMNA | |
| SCHEMBL394289 | 0.89 | KCNMA1 (0.79) | KCNMA1GAAHTTALDH1A1CYP1A2 | |
| SCHEMBL7759260 | 0.88 | KCNMA1 (1.00) | KCNMA1GAANPC1HTTLMNA | |
| SCHEMBL5357012 | 0.87 | KCNMA1 (0.68) | KCNMA1GAANPC1HTTLMNA | |
| SCHEMBL7722700 | 0.84 | ALDH1A1 (0.68) | KCNMA1GAAHTTALDH1A1CYP1A2 | |
| SCHEMBL4958316 | 0.84 | KCNMA1 (0.64) | KCNMA1GAAHTTALDH1A1CYP1A2 | |
| SCHEMBL4958325 | 0.84 | KCNMA1 (0.64) | KCNMA1GAAHTTALDH1A1CYP1A2 | |
| SCHEMBL222014 | 0.83 | HTT (0.65) | KCNMA1GAAHTTLMNAALDH1A1 | |
| SCHEMBL5226740 | 0.83 | KCNMA1 (0.67) | KCNMA1GAANPC1HTTALDH1A1 | |
| SCHEMBL7717663 | 0.83 | ALDH1A1 (0.66) | KCNMA1GAAHTTALDH1A1CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105732519-A | Synthetic method of nitrogenous heterocyclic compound | 武汉理工大学 | 2016-07-06 | — | — | CN | claimed |
| CN-105732519-A | Synthetic method of nitrogenous heterocyclic compound | 武汉理工大学 | 2016-07-06 | — | — | CN | disclosed |